(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-acetyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-acetyl-1-methyl-2-pyrrolecarboxylic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-acetyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-acetyl-1-methyl-pyrrole-2-carboxylic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C17H16BrNO5 MolecularWeight: 394.21664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C(=C1)C(=O)OCC2=CC3=C(C=C2Br)OCCO3)C

Isomeric SMILES

CC(=O)C1=CN(C(=C1)C(=O)OCC2=CC3=C(C=C2Br)OCCO3)C

InChI

InChI=1S/C17H16BrNO5/c1-10(20)11-5-14(19(2)8-11)17(21)24-9-12-6-15-16(7-13(12)18)23-4-3-22-15/h5-8H,3-4,9H2,1-2H3